Li3VPCO7

Li3VPCO7 is a metastable vanadium phosphate material utilized in the research and development of advanced lithium-ion battery cathodes.

Crystal structure of Li3VPCO7
Ground-state structure · Materials Project
Overview

About Li3VPCO7

Li3VPCO7 belongs to the class of vanadium phosphate cathodes, a group of materials widely investigated for their potential in electrochemical energy storage. As a wide-band-gap insulator, this compound exhibits distinct electronic characteristics that influence its behavior during charge and discharge cycles in battery architectures.

Although it is classified as a metastable phase, the structural complexity of Li3VPCO7 makes it a subject of interest for researchers studying ion transport and lattice stability. Its unique composition of lithium, vanadium, phosphorus, carbon, and oxygen provides a framework for exploring alternative cathode chemistries beyond traditional transition metal oxides.

At a glance

Key Properties

Cross-validated computational properties for Li3VPCO7, aggregated across 2 databases.

Band Gap

0.57–3.06 eV
Range across DFT structures

Energy Above Hull

0.069 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

13
2 databases, 4 space groups
Uses

Applications

Where Li3VPCO7 is used.

Lithium-ion battery cathode researchEnergy storage material development
Reference

Frequently Asked Questions

Common questions about Li3VPCO7, answered from cross-validated data.

What is Li3VPCO7?

Li3VPCO7 is a metastable vanadium phosphate material utilized in the research and development of advanced lithium-ion battery cathodes.

More questions
What is Li3VPCO7 used for?
Li3VPCO7 is used in lithium-ion battery cathode research and energy storage material development.
What is the band gap of Li3VPCO7?
Li3VPCO7 has a DFT-computed band gap of 0.57–3.06 eV across 13 reported structures.
Is Li3VPCO7 a metal, semiconductor, or insulator?
With a wide band gap up to 3.06 eV it is an insulator / wide-band-gap material.
Is Li3VPCO7 thermodynamically stable?
Li3VPCO7 has a lowest energy above hull of 0.069 eV/atom (metastable).
How many polymorphs of Li3VPCO7 are known?
13 structures of Li3VPCO7 are reported across 2 databases, spanning 4 distinct space groups.
What elements does Li3VPCO7 contain?
Li3VPCO7 contains C, Li, O, P, and V (5 elements).
Where does the data for Li3VPCO7 come from?
Li3VPCO7 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the vanadium phosphate cathodes class.

Within the diverse family of vanadium phosphate cathodes, Li3VPCO7 occupies a specialized niche compared to more common members like LiVPO4. While many of its siblings are extensively characterized for their stable cycling performance, Li3VPCO7 represents a more complex, metastable structural arrangement that highlights the compositional flexibility inherent in the vanadium-phosphorus-oxygen system.

Explore

Related Compounds

Other Vanadium Phosphate Cathodes in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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